SCHEMBL19429619

SCHEMBL19429619

CC1CCC(c2ccc3c(N)ncnn23)CC1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A2 P19784 2/20 0.38
▸ CSNK2A1 P68400 2/20 0.38
▸ MAP4K4 O95819 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ ACVRL1 P37023 4/20 0.36
▸ DOT1L Q8TEK3 3/20 0.34
▸ MTOR P42345 1/20 0.32
▸ RICTOR Q6R327 1/20 0.32
▸ RPTOR Q8N122 1/20 0.32
▸ MAPKAP1 Q9BPZ7 1/20 0.32
▸ MLST8 Q9BVC4 1/20 0.32
▸ TNK2 Q07912 4/20 0.32
▸ POLRMT O00411 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20960065 0.93 MAP4K4 (0.37) CSNK2A2CSNK2A1MAP4K4KDM4EHTT
SCHEMBL31391115 0.92 MAP4K4 (0.43) MAP4K4KDM4EHTTACVRL1DOT1L
SCHEMBL16011257 0.85 ACVRL1 (0.46) CSNK2A2CSNK2A1MAP4K4ACVRL1DOT1L
SCHEMBL16011256 0.85 ACVRL1 (0.46) CSNK2A2CSNK2A1MAP4K4ACVRL1DOT1L
SCHEMBL19377633 0.84 AXL (0.39) MAP4K4ACVRL1DOT1L
SCHEMBL19377694 0.82 PIK3CD (0.42) CSNK2A2CSNK2A1MAP4K4
SCHEMBL22627061 0.82 ACVRL1 (0.51) MAP4K4ACVRL1ALDH1A1
SCHEMBL19377637 0.82 EGLN2 (0.40) MAP4K4KDM4EHTTACVRL1DOT1L
SCHEMBL14488031 0.81 MAP4K4 (0.37) CSNK2A2CSNK2A1MAP4K4ACVRL1DOT1L
SCHEMBL21120475 0.81 DOT1L (0.35) MAP4K4ACVRL1DOT1LTNK2POLRMT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017172596-A1 PYRROLOTRIAZINE COMPOUNDS AS TAM INHIBITORS INCYTE CORPORATION (US) 2017-10-05 — — WO disclosed
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